ChemSpider 2D Image | 1-{4-[2-Oxo-1-(2,2,2-trifluoroethyl)-3-piperidinyl]-1-piperazinyl}-2-(1-pyrrolidinyl)-1,2-ethanedione | C17H25F3N4O3

1-{4-[2-Oxo-1-(2,2,2-trifluoroethyl)-3-piperidinyl]-1-piperazinyl}-2-(1-pyrrolidinyl)-1,2-ethanedione

  • Molecular FormulaC17H25F3N4O3
  • Average mass390.401 Da
  • Monoisotopic mass390.187866 Da
  • ChemSpider ID67914016

More details:

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

1,2-Ethanedione, 1-[4-[2-oxo-1-(2,2,2-trifluoroethyl)-3-piperidinyl]-1-piperazinyl]-2-(1-pyrrolidinyl)- [ACD/Index Name]
1-{4-[2-Oxo-1-(2,2,2-trifluorethyl)-3-piperidinyl]-1-piperazinyl}-2-(1-pyrrolidinyl)-1,2-ethandion [German] [ACD/IUPAC Name]
1-{4-[2-Oxo-1-(2,2,2-trifluoroethyl)-3-piperidinyl]-1-piperazinyl}-2-(1-pyrrolidinyl)-1,2-ethanedione [ACD/IUPAC Name]
1-{4-[2-Oxo-1-(2,2,2-trifluoroéthyl)-3-pipéridinyl]-1-pipérazinyl}-2-(1-pyrrolidinyl)-1,2-éthanedione [French] [ACD/IUPAC Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.3±0.1 g/cm3
Boiling Point: 490.9±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 75.8±3.0 kJ/mol
Flash Point: 250.7±31.5 °C
Index of Refraction: 1.526
Molar Refractivity: 89.3±0.3 cm3
#H bond acceptors: 7
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: -0.35
ACD/LogD (pH 5.5): -0.18
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 17.94
ACD/LogD (pH 7.4): -0.12
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 20.53
Polar Surface Area: 64 Å2
Polarizability: 35.4±0.5 10-24cm3
Surface Tension: 47.8±3.0 dyne/cm
Molar Volume: 290.9±3.0 cm3

Click to predict properties on the Chemicalize site


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